SCHEMBL3059841

SCHEMBL3059841

C=C(C)C(=O)OC.C=CCCCC

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
TSHR P16473 8/20 0.52
LMNA P02545 1/20 0.46
PLA2G2C Q5R387 1/20 0.39
HPGD P15428 1/20 0.36
FAAH O00519 1/20 0.36
THRB P10828 1/20 0.35
POLB P06746 1/20 0.35
POLA1 P09884 1/20 0.35
ABCC4 O15439 1/20 0.34
MAPT P10636 1/20 0.34
ATM Q13315 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28109833 0.93 TSHR (0.55) ALDH1A1TSHRLMNAPLA2G2CFAAH
Hexane SCHEMBL27951935 0.84 ALDH1A1 (0.71) ALDH1A1TSHRFAAHTHRBPOLB
SCHEMBL679802 0.83 ALDH1A1 (0.48) ALDH1A1TSHRLMNAPOLBMAPT
Heptane SCHEMBL8159285 0.82 ALDH1A1 (0.68) ALDH1A1TSHRTHRBPOLBPOLA1
Methacrylic Acid SCHEMBL18759149 0.80 TSHR (0.61) ALDH1A1TSHRLMNAABCC4MAPT
SCHEMBL11368182 0.80 ALDH1A1 (0.77) ALDH1A1TSHRLMNAHPGDPOLB
SCHEMBL1345248 0.80 ALDH1A1 (0.48) ALDH1A1TSHRTHRB
Butane SCHEMBL7941631 0.80 ALDH1A1 (0.79) ALDH1A1TSHRLMNATHRB
Acetone SCHEMBL4681458 0.80 TSHR (0.74) ALDH1A1TSHRLMNAPLA2G2CHPGD
SCHEMBL4219856 0.79 ALDH1A1 (0.52) ALDH1A1TSHRPLA2G2CHPGDFAAH

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107614634-B Natural drying type water-based paint compositions 日本油漆株式会社 2019-03-01 CN disclosed
CN-107614634-A Natural drying type water-based paint compositions 日本油漆株式会社 2018-01-19 CN disclosed
US-20100261857-A1 OLEFIN/(METH)ACRYLATE BLOCK COPOLYMER AND METHOD FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-10-14 US disclosed
CN-101802035-A Olefin/(meth)acrylate block copolymer and method for producing the same SUMITOMO CHEMICAL CO 2010-08-11 CN disclosed
EP-2189483-A1 OLEFIN/(METH)ACRYLATE BLOCK COPOLYMER AND METHOD FOR PRODUCING THE SAME Sumitomo Chemical Company, Limited (JP) 2010-05-26 EP disclosed